Basic information
- CAS
5804-10-4- Standard SMILES
CCCCCCCCOc1ccc(N)cc1COc1ccc(N)cc1OC- InChIKey
UBHBHXBLULCGHT-UHFFFAOYSA-N- Molecular formula
- C22H32N2O3
- Average molar mass
- 372.5 g/mol
- Monoisotopic mass
- 372.24129288
Names & identifiers
- Preferred name
- m-Toluidine, alpha-(4-amino-2-methoxyphenoxy)-4-(octyloxy)-
- IUPAC
- 3-[(4-amino-2-methoxyphenoxy)methyl]-4-octoxyaniline
Names & synonyms
m-Toluidine, alpha-(4-amino-2-methoxyphenoxy)-4-(octyloxy)-5804-10-4M & B 6076BRN 2785194DTXSID40206761alpha-(4-Amino-2-methoxyphenoxy)-4-(octyloxy)-m-toluidineRefChem:351597DTXCID701292523-[(4-amino-2-methoxyphenoxy)methyl]-4-octoxyaniline4-((5-Amino-2-(octyloxy)benzyl)oxy)-3-methoxyanilinestarbld0015806orb1985587
Show more names
AKOS040753166T335273-[(4-amino-2-methoxyphenoxy)methyl]-4-(octyloxy)aniline
Database identifiers
- CAS
5804-10-4- PubChem CID
- 201322
- DTXSID
DTXSID40206761
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 79.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 383
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…